N-(2-aminophenyl)-5-[[2-(4-methoxyphenyl)ethanoylamino]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-5-[[2-(4-methoxyphenyl)ethanoylamino]methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-5-[[[2-(4-methoxyphenyl)acetyl]amino]methyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-5-[[[2-(4-methoxyphenyl)-1-oxoethyl]amino]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-5-[[[2-(4-methoxyphenyl)acetyl]amino]methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-5-[[[2-(4-methoxyphenyl)acetyl]amino]methyl]benzothiophene-2-carboxamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NCC2=CC3=C(C=C2)SC(=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NCC2=CC3=C(C=C2)SC(=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C25H23N3O3S/c1-31-19-9-6-16(7-10-19)13-24(29)27-15-17-8-11-22-18(12-17)14-23(32-22)25(30)28-21-5-3-2-4-20(21)26/h2-12,14H,13,15,26H2,1H3,(H,27,29)(H,28,30)